Name: BMS-457
Rating: 5 (10 reviews)

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HIT ID:HIT212712277
Cas No:946594-19-0
常用名:BMS-457
IUPAC:(1R,3R)-N-[(2R)-1-[(4S)-4-(4-chlorophenyl)-4-hydroxy-3,3-dimethylpiperidin-1-yl]-3-methyl-1-oxobutan-2-yl]-3-hydroxycyclopentane-1-carboxamide
IUPAC:(1R,3R)-N-[(2R)-1-[(4S)-4-(4-chlorophenyl)-4-hydroxy-3,3-dimethylpiperidin-1-yl]-3-methyl-1-oxobutan-2-yl]-3-hydroxycyclopentane-1-carboxamide
InChI key:WIHIXSCKSFSENF-YBNJHJSASA-N

分子式:C24H35ClN2O4
分子量:451
氢键供体数 (HBD):3
氢键受体数 (HBA):4
LogP:2.5922763
SMILES:CC(C)[C@@H](NC(=O)[C@@H]1CC[C@@H](O)C1)C(=O)N1CC[C@](O)(c2ccc(Cl)cc2)C(C)(C)C1
SMILES:CC(C)[C@@H](NC(=O)[C@@H]1CC[C@@H](O)C1)C(=O)N1CC[C@](O)(c2ccc(Cl)cc2)C(C)(C)C1

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